4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide

C22H26N2O2 — CID 109047024

IUPAC4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide
SMILESCC1CCCN(C(=O)c2ccc(C(=O)NC(C)c3ccccc3)cc2)C1
InChIInChI=1S/C22H26N2O2/c1-16-7-6-14-24(15-16)22(26)20-12-10-19(11-13-20)21(25)23-17(2)18-8-4-3-5-9-18/h3-5,8-13,16-17H,6-7,14-15H2,1-2H3,(H,23,25)
InChIKeySFOWMYYPDLNBFY-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.05
Rot. Bonds4

About 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide

4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide (PubChem CID 109047024) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide
PubChem CID109047024
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide
SMILESCC1CCCN(C(=O)c2ccc(C(=O)NC(C)c3ccccc3)cc2)C1
InChIInChI=1S/C22H26N2O2/c1-16-7-6-14-24(15-16)22(26)20-12-10-19(11-13-20)21(25)23-17(2)18-8-4-3-5-9-18/h3-5,8-13,16-17H,6-7,14-15H2,1-2H3,(H,23,25)
InChIKeySFOWMYYPDLNBFY-UHFFFAOYSA-N
XLogP4.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)pyridine-3-carboxamide
CID 109105362
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109086112
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzenesulfonamide
CID 109060714
N-[(1R)-1-[4-[(3S)-3-methylpiperidin-1-yl]phenyl]ethyl]-4-phenylbenzamide
CID 125042587
4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047837
1-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109070429
[4-(3-methylpiperidine-1-carbonyl)phenyl]-(4-phenylpiperazin-1-yl)methanone
CID 109048199
4-(4-methylpiperidin-1-yl)sulfonyl-N-[(1R)-1-phenylethyl]benzamide
CID 7536036
2-(3-methylpiperidin-1-yl)-N-(1-phenylethyl)propanamide
CID 46800680
1-[4-[4-(3-methylpiperidine-1-carbonyl)benzoyl]piperazin-1-yl]ethanone
CID 109046471
(4-fluorophenyl)-(3-methylpiperidin-1-yl)methanone
CID 3113489
N-[(2-methylphenyl)methyl]-4-(3-methylpiperidine-1-carbonyl)benzamide
CID 109046805

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide?
The IUPAC name of 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide (CID 109047024) is 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide?
The canonical SMILES for 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide is CC1CCCN(C(=O)c2ccc(C(=O)NC(C)c3ccccc3)cc2)C1.
What is the InChIKey of 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide?
The InChIKey is SFOWMYYPDLNBFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-16-7-6-14-24(15-16)22(26)20-12-10-19(11-13-20)21(25)23-17(2)18-8-4-3-5-9-18/h3-5,8-13,16-17H,6-7,14-15H2,1-2H3,(H,23,25).
What are the key properties of 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide?
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide has a molecular weight of 350.46 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 109047024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).